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	hartrees
Energy at 0K	-94.004376
Energy at 298.15K	-94.007290
HF Energy	-94.004376
Nuclear repulsion energy	32.172375

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3322	3304	2.11	119.52	0.45	0.62
2	A'	3023	3006	123.56	449.37	0.33	0.50
3	A'	2691	2676	158.19	134.95	0.59	0.74
4	A'	1700	1690	1.12	46.23	0.41	0.58
5	A'	1410	1402	27.61	10.80	0.72	0.84
6	A'	1273	1266	5.06	1.36	0.71	0.83
7	A'	1055	1049	39.05	26.08	0.53	0.69
8	A"	1133	1127	11.07	1.23	0.75	0.86
9	A"	859	854	207.49	2.72	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.806
N2	0.063	-0.532
H3	-1.030	1.106
H4	-0.754	-1.188
H5	0.966	-1.028

	C1	N2	H3	H4	H5
C1		1.3374	1.1335	2.1545	2.0445
N2	1.3374		1.9689	1.0477	1.0310
H3	1.1335	1.9689		2.3104	2.9225
H4	2.1545	1.0477	2.3104		1.7276
H5	2.0445	1.0310	2.9225	1.7276

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	128.780		C1	N2	H5	118.794
N2	C1	H3	105.358		H4	N2	H5	112.426

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: BLYP/3-21G

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Number	Element	Mulliken
1	C	-0.075
2	N	-0.613
3	H	0.112
4	H	0.265
5	H	0.311

	x	y	z	Total
	-1.139	-3.224	0.000	3.420
CHELPG
AIM
ESP

	x	y	z
x	2.678	-0.199	0.000
y	-0.199	3.755	0.000
z	0.000	0.000	1.181

<r²>	20.180
(<r²>)^1/2	4.492

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: BLYP/3-21G

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)